[3-(furan-2-ylcarbonylamino)phenyl] 4-fluoranyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: [3-(furan-2-ylcarbonylamino)phenyl] 4-fluoranyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: [3-(furan-2-carbonylamino)phenyl] 4-fluoro-3-morpholinosulfonyl-benzoate CAS Name: 4-fluoro-3-(4-morpholinylsulfonyl)benzoic acid [3-[[2-furanyl(oxo)methyl]amino]phenyl] ester IUPAC Name: [3-(furan-2-carbonylamino)phenyl] 4-fluoro-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-fluoro-3-morpholinosulfonyl-benzoic acid [3-(2-furoylamino)phenyl] ester Formula: C22H19FN2O7S MolecularWeight: 474.458863

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC=CC(=C3)NC(=O)C4=CC=CO4)F

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC=CC(=C3)NC(=O)C4=CC=CO4)F

InChI

InChI=1S/C22H19FN2O7S/c23-18-7-6-15(13-20(18)33(28,29)25-8-11-30-12-9-25)22(27)32-17-4-1-3-16(14-17)24-21(26)19-5-2-10-31-19/h1-7,10,13-14H,8-9,11-12H2,(H,24,26)